data_52041 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 52041 _Entry.Title ; AtMed25ACID + DREB2A ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2023-07-15 _Entry.Accession_date 2023-07-15 _Entry.Last_release_date 2023-07-17 _Entry.Original_release_date 2023-07-17 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'Chemical shifts of Arabidopsis thaliana Med25ACID 532-680 in complex with transcription factor DREB2A 234-276' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Frederik Theisen . F. . 0000-0002-3412-4242 52041 2 Andreas Prestel . . . 0000-0002-5459-9608 52041 3 Yannick Leurs . H.A. . 0000-0002-5507-7174 52041 4 Birthe Kragelund . B. . 0000-0002-7454-1761 52041 5 Karen Skriver . . . 0000-0003-2225-4012 52041 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'University of Copenhagen' . 52041 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 52041 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '15N chemical shifts' 138 52041 '1H chemical shifts' 138 52041 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2024-02-06 2023-07-15 update BMRB 'update entry citation' 52041 1 . . 2023-07-21 2023-07-15 original author 'original release' 52041 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 52040 'Med25ACID Unbound' 52041 BMRB 52042 'AtMed25ACID + DREB2A ABS' 52041 BMRB 52043 'AtMed25ACID + DREB2A RIM' 52041 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 52041 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 38238333 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Molecular switching in transcription through splicing and proline-isomerization regulates stress responses in plants ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Comm.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 15 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 592 _Citation.Page_last 592 _Citation.Year 2024 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Frederik Theisen . F. . . 52041 1 2 Andreas Prestel . . . . 52041 1 3 Steffie Elkjaer . M.H. . . 52041 1 4 Yannick Leurs . H.A. . . 52041 1 5 Nicholas Morffy . . . . 52041 1 6 Lucia Strader . C. . . 52041 1 7 Charlotte O'shea . . . . 52041 1 8 Kaare Teilum . . . . 52041 1 9 Birthe Kragelund . B. . . 52041 1 10 Karen Skriver . . . . 52041 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 52041 _Assembly.ID 1 _Assembly.Name Med25ACID+DREB2A _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states yes _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange yes _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 Med25 1 $entity_1 . . yes native yes no . . . 52041 1 2 DREB2A 2 $entity_2 . . no native yes no . . . 52041 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 52041 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSNSSAPNMQLSQPSSGAMQ TSQSKYVKVWEGNLSGQRQG QPVLITRLEGYRSASASDSL AANWPPTMQIVRLISQDHMN NKQYVGKADFLVFRAMSQHG FLGQLQDKKLCAVIQLPSQT LLLSVSDKACRLIGMLFPGD MVVFKPQIPN ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Med25ACID 532-680' _Entity.Ambiguous_conformational_states yes _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 150 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 531 GLY . 52041 1 2 532 SER . 52041 1 3 533 ASN . 52041 1 4 534 SER . 52041 1 5 535 SER . 52041 1 6 536 ALA . 52041 1 7 537 PRO . 52041 1 8 538 ASN . 52041 1 9 539 MET . 52041 1 10 540 GLN . 52041 1 11 541 LEU . 52041 1 12 542 SER . 52041 1 13 543 GLN . 52041 1 14 544 PRO . 52041 1 15 545 SER . 52041 1 16 546 SER . 52041 1 17 547 GLY . 52041 1 18 548 ALA . 52041 1 19 549 MET . 52041 1 20 550 GLN . 52041 1 21 551 THR . 52041 1 22 552 SER . 52041 1 23 553 GLN . 52041 1 24 554 SER . 52041 1 25 555 LYS . 52041 1 26 556 TYR . 52041 1 27 557 VAL . 52041 1 28 558 LYS . 52041 1 29 559 VAL . 52041 1 30 560 TRP . 52041 1 31 561 GLU . 52041 1 32 562 GLY . 52041 1 33 563 ASN . 52041 1 34 564 LEU . 52041 1 35 565 SER . 52041 1 36 566 GLY . 52041 1 37 567 GLN . 52041 1 38 568 ARG . 52041 1 39 569 GLN . 52041 1 40 570 GLY . 52041 1 41 571 GLN . 52041 1 42 572 PRO . 52041 1 43 573 VAL . 52041 1 44 574 LEU . 52041 1 45 575 ILE . 52041 1 46 576 THR . 52041 1 47 577 ARG . 52041 1 48 578 LEU . 52041 1 49 579 GLU . 52041 1 50 580 GLY . 52041 1 51 581 TYR . 52041 1 52 582 ARG . 52041 1 53 583 SER . 52041 1 54 584 ALA . 52041 1 55 585 SER . 52041 1 56 586 ALA . 52041 1 57 587 SER . 52041 1 58 588 ASP . 52041 1 59 589 SER . 52041 1 60 590 LEU . 52041 1 61 591 ALA . 52041 1 62 592 ALA . 52041 1 63 593 ASN . 52041 1 64 594 TRP . 52041 1 65 595 PRO . 52041 1 66 596 PRO . 52041 1 67 597 THR . 52041 1 68 598 MET . 52041 1 69 599 GLN . 52041 1 70 600 ILE . 52041 1 71 601 VAL . 52041 1 72 602 ARG . 52041 1 73 603 LEU . 52041 1 74 604 ILE . 52041 1 75 605 SER . 52041 1 76 606 GLN . 52041 1 77 607 ASP . 52041 1 78 608 HIS . 52041 1 79 609 MET . 52041 1 80 610 ASN . 52041 1 81 611 ASN . 52041 1 82 612 LYS . 52041 1 83 613 GLN . 52041 1 84 614 TYR . 52041 1 85 615 VAL . 52041 1 86 616 GLY . 52041 1 87 617 LYS . 52041 1 88 618 ALA . 52041 1 89 619 ASP . 52041 1 90 620 PHE . 52041 1 91 621 LEU . 52041 1 92 622 VAL . 52041 1 93 623 PHE . 52041 1 94 624 ARG . 52041 1 95 625 ALA . 52041 1 96 626 MET . 52041 1 97 627 SER . 52041 1 98 628 GLN . 52041 1 99 629 HIS . 52041 1 100 630 GLY . 52041 1 101 631 PHE . 52041 1 102 632 LEU . 52041 1 103 633 GLY . 52041 1 104 634 GLN . 52041 1 105 635 LEU . 52041 1 106 636 GLN . 52041 1 107 637 ASP . 52041 1 108 638 LYS . 52041 1 109 639 LYS . 52041 1 110 640 LEU . 52041 1 111 641 CYS . 52041 1 112 642 ALA . 52041 1 113 643 VAL . 52041 1 114 644 ILE . 52041 1 115 645 GLN . 52041 1 116 646 LEU . 52041 1 117 647 PRO . 52041 1 118 648 SER . 52041 1 119 649 GLN . 52041 1 120 650 THR . 52041 1 121 651 LEU . 52041 1 122 652 LEU . 52041 1 123 653 LEU . 52041 1 124 654 SER . 52041 1 125 655 VAL . 52041 1 126 656 SER . 52041 1 127 657 ASP . 52041 1 128 658 LYS . 52041 1 129 659 ALA . 52041 1 130 660 CYS . 52041 1 131 661 ARG . 52041 1 132 662 LEU . 52041 1 133 663 ILE . 52041 1 134 664 GLY . 52041 1 135 665 MET . 52041 1 136 666 LEU . 52041 1 137 667 PHE . 52041 1 138 668 PRO . 52041 1 139 669 GLY . 52041 1 140 670 ASP . 52041 1 141 671 MET . 52041 1 142 672 VAL . 52041 1 143 673 VAL . 52041 1 144 674 PHE . 52041 1 145 675 LYS . 52041 1 146 676 PRO . 52041 1 147 677 GLN . 52041 1 148 678 ILE . 52041 1 149 679 PRO . 52041 1 150 680 ASN . 52041 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 52041 1 . SER 2 2 52041 1 . ASN 3 3 52041 1 . SER 4 4 52041 1 . SER 5 5 52041 1 . ALA 6 6 52041 1 . PRO 7 7 52041 1 . ASN 8 8 52041 1 . MET 9 9 52041 1 . GLN 10 10 52041 1 . LEU 11 11 52041 1 . SER 12 12 52041 1 . GLN 13 13 52041 1 . PRO 14 14 52041 1 . SER 15 15 52041 1 . SER 16 16 52041 1 . GLY 17 17 52041 1 . ALA 18 18 52041 1 . MET 19 19 52041 1 . GLN 20 20 52041 1 . THR 21 21 52041 1 . SER 22 22 52041 1 . GLN 23 23 52041 1 . SER 24 24 52041 1 . LYS 25 25 52041 1 . TYR 26 26 52041 1 . VAL 27 27 52041 1 . LYS 28 28 52041 1 . VAL 29 29 52041 1 . TRP 30 30 52041 1 . GLU 31 31 52041 1 . GLY 32 32 52041 1 . ASN 33 33 52041 1 . LEU 34 34 52041 1 . SER 35 35 52041 1 . GLY 36 36 52041 1 . GLN 37 37 52041 1 . ARG 38 38 52041 1 . GLN 39 39 52041 1 . GLY 40 40 52041 1 . GLN 41 41 52041 1 . PRO 42 42 52041 1 . VAL 43 43 52041 1 . LEU 44 44 52041 1 . ILE 45 45 52041 1 . THR 46 46 52041 1 . ARG 47 47 52041 1 . LEU 48 48 52041 1 . GLU 49 49 52041 1 . GLY 50 50 52041 1 . TYR 51 51 52041 1 . ARG 52 52 52041 1 . SER 53 53 52041 1 . ALA 54 54 52041 1 . SER 55 55 52041 1 . ALA 56 56 52041 1 . SER 57 57 52041 1 . ASP 58 58 52041 1 . SER 59 59 52041 1 . LEU 60 60 52041 1 . ALA 61 61 52041 1 . ALA 62 62 52041 1 . ASN 63 63 52041 1 . TRP 64 64 52041 1 . PRO 65 65 52041 1 . PRO 66 66 52041 1 . THR 67 67 52041 1 . MET 68 68 52041 1 . GLN 69 69 52041 1 . ILE 70 70 52041 1 . VAL 71 71 52041 1 . ARG 72 72 52041 1 . LEU 73 73 52041 1 . ILE 74 74 52041 1 . SER 75 75 52041 1 . GLN 76 76 52041 1 . ASP 77 77 52041 1 . HIS 78 78 52041 1 . MET 79 79 52041 1 . ASN 80 80 52041 1 . ASN 81 81 52041 1 . LYS 82 82 52041 1 . GLN 83 83 52041 1 . TYR 84 84 52041 1 . VAL 85 85 52041 1 . GLY 86 86 52041 1 . LYS 87 87 52041 1 . ALA 88 88 52041 1 . ASP 89 89 52041 1 . PHE 90 90 52041 1 . LEU 91 91 52041 1 . VAL 92 92 52041 1 . PHE 93 93 52041 1 . ARG 94 94 52041 1 . ALA 95 95 52041 1 . MET 96 96 52041 1 . SER 97 97 52041 1 . GLN 98 98 52041 1 . HIS 99 99 52041 1 . GLY 100 100 52041 1 . PHE 101 101 52041 1 . LEU 102 102 52041 1 . GLY 103 103 52041 1 . GLN 104 104 52041 1 . LEU 105 105 52041 1 . GLN 106 106 52041 1 . ASP 107 107 52041 1 . LYS 108 108 52041 1 . LYS 109 109 52041 1 . LEU 110 110 52041 1 . CYS 111 111 52041 1 . ALA 112 112 52041 1 . VAL 113 113 52041 1 . ILE 114 114 52041 1 . GLN 115 115 52041 1 . LEU 116 116 52041 1 . PRO 117 117 52041 1 . SER 118 118 52041 1 . GLN 119 119 52041 1 . THR 120 120 52041 1 . LEU 121 121 52041 1 . LEU 122 122 52041 1 . LEU 123 123 52041 1 . SER 124 124 52041 1 . VAL 125 125 52041 1 . SER 126 126 52041 1 . ASP 127 127 52041 1 . LYS 128 128 52041 1 . ALA 129 129 52041 1 . CYS 130 130 52041 1 . ARG 131 131 52041 1 . LEU 132 132 52041 1 . ILE 133 133 52041 1 . GLY 134 134 52041 1 . MET 135 135 52041 1 . LEU 136 136 52041 1 . PHE 137 137 52041 1 . PRO 138 138 52041 1 . GLY 139 139 52041 1 . ASP 140 140 52041 1 . MET 141 141 52041 1 . VAL 142 142 52041 1 . VAL 143 143 52041 1 . PHE 144 144 52041 1 . LYS 145 145 52041 1 . PRO 146 146 52041 1 . GLN 147 147 52041 1 . ILE 148 148 52041 1 . PRO 149 149 52041 1 . ASN 150 150 52041 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 52041 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GQDSLSVADYGWPNDVDQSH LDSSDMFDVDELLRDLNGDD VFAG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Gly-DREB2A 234-276' _Entity.Ambiguous_conformational_states yes _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 44 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment DREB2A_234-276 _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 52041 2 2 . GLN . 52041 2 3 . ASP . 52041 2 4 . SER . 52041 2 5 . LEU . 52041 2 6 . SER . 52041 2 7 . VAL . 52041 2 8 . ALA . 52041 2 9 . ASP . 52041 2 10 . TYR . 52041 2 11 . GLY . 52041 2 12 . TRP . 52041 2 13 . PRO . 52041 2 14 . ASN . 52041 2 15 . ASP . 52041 2 16 . VAL . 52041 2 17 . ASP . 52041 2 18 . GLN . 52041 2 19 . SER . 52041 2 20 . HIS . 52041 2 21 . LEU . 52041 2 22 . ASP . 52041 2 23 . SER . 52041 2 24 . SER . 52041 2 25 . ASP . 52041 2 26 . MET . 52041 2 27 . PHE . 52041 2 28 . ASP . 52041 2 29 . VAL . 52041 2 30 . ASP . 52041 2 31 . GLU . 52041 2 32 . LEU . 52041 2 33 . LEU . 52041 2 34 . ARG . 52041 2 35 . ASP . 52041 2 36 . LEU . 52041 2 37 . ASN . 52041 2 38 . GLY . 52041 2 39 . ASP . 52041 2 40 . ASP . 52041 2 41 . VAL . 52041 2 42 . PHE . 52041 2 43 . ALA . 52041 2 44 . GLY . 52041 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 52041 2 . GLN 2 2 52041 2 . ASP 3 3 52041 2 . SER 4 4 52041 2 . LEU 5 5 52041 2 . SER 6 6 52041 2 . VAL 7 7 52041 2 . ALA 8 8 52041 2 . ASP 9 9 52041 2 . TYR 10 10 52041 2 . GLY 11 11 52041 2 . TRP 12 12 52041 2 . PRO 13 13 52041 2 . ASN 14 14 52041 2 . ASP 15 15 52041 2 . VAL 16 16 52041 2 . ASP 17 17 52041 2 . GLN 18 18 52041 2 . SER 19 19 52041 2 . HIS 20 20 52041 2 . LEU 21 21 52041 2 . ASP 22 22 52041 2 . SER 23 23 52041 2 . SER 24 24 52041 2 . ASP 25 25 52041 2 . MET 26 26 52041 2 . PHE 27 27 52041 2 . ASP 28 28 52041 2 . VAL 29 29 52041 2 . ASP 30 30 52041 2 . GLU 31 31 52041 2 . LEU 32 32 52041 2 . LEU 33 33 52041 2 . ARG 34 34 52041 2 . ASP 35 35 52041 2 . LEU 36 36 52041 2 . ASN 37 37 52041 2 . GLY 38 38 52041 2 . ASP 39 39 52041 2 . ASP 40 40 52041 2 . VAL 41 41 52041 2 . PHE 42 42 52041 2 . ALA 43 43 52041 2 . GLY 44 44 52041 2 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 52041 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 3702 organism . 'Arabidopsis thaliana' 'Thale cress' . . Eukaryota Viridiplantae Arabidopsis thaliana . . . . . . . . . . . . . 52041 1 2 2 $entity_2 . 3702 organism . 'Arabidopsis thaliana' 'Thale cress' . . Eukaryota Viridiplantae Arabidopsis thaliana . . . . . . . . . . . . . 52041 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 52041 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 DE3 . plasmid . . 'pGEX 4t1' . . . 52041 1 2 2 $entity_2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 DE3 . plasmid . . 'pGEX 4T1' . . . 52041 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 52041 _Sample.ID 1 _Sample.Name 'Med25ACID+DREB2A ABS-RIM' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Med25ACID '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 110 . . uM . . . . 52041 1 2 'DREB2A 234-276' 'natural abundance' . . 2 $entity_2 . . 220 . . uM . . . . 52041 1 3 'Sodium Phosphate buffer' 'natural abundance' . . . . . . 20 . . mM . . . . 52041 1 4 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 52041 1 5 DTT 'natural abundance' . . . . . . 5 . . mM . . . . 52041 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 52041 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'Experimental conditions' _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 . mM 52041 1 pH 6.5 . pH 52041 1 pressure 1 . atm 52041 1 temperature 298.15 . K 52041 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 52041 _Software.ID 1 _Software.Type . _Software.Name CcpNMR _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 52041 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 52041 _Software.ID 2 _Software.Type . _Software.Name qMDD _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 52041 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 52041 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker AVANCE 600' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 52041 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name 'Bruker AVANCE 750' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 52041 _NMR_spectrometer.ID 3 _NMR_spectrometer.Name 'Bruker AVANCE 800' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 52041 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52041 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 52041 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name Ref _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.23503 . . . . . 52041 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 52041 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.15751 . . . . . 52041 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 52041 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name ABS-RIM _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 52041 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 52041 1 2 $software_2 . . 52041 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 4 4 SER H H 1 8.335 0.000 . 1 . . . . . 534 SER H . 52041 1 2 . 1 . 1 4 4 SER N N 15 116.366 0.000 . 1 . . . . . 534 SER N . 52041 1 3 . 1 . 1 5 5 SER H H 1 8.339 0.000 . 1 . . . . . 535 SER H . 52041 1 4 . 1 . 1 5 5 SER N N 15 117.868 0.000 . 1 . . . . . 535 SER N . 52041 1 5 . 1 . 1 6 6 ALA H H 1 8.196 0.000 . 1 . . . . . 536 ALA H . 52041 1 6 . 1 . 1 6 6 ALA N N 15 126.940 0.000 . 1 . . . . . 536 ALA N . 52041 1 7 . 1 . 1 8 8 ASN H H 1 8.475 0.000 . 1 . . . . . 538 ASN H . 52041 1 8 . 1 . 1 8 8 ASN N N 15 117.919 0.000 . 1 . . . . . 538 ASN N . 52041 1 9 . 1 . 1 9 9 MET H H 1 8.302 0.000 . 1 . . . . . 539 MET H . 52041 1 10 . 1 . 1 9 9 MET N N 15 121.030 0.000 . 1 . . . . . 539 MET N . 52041 1 11 . 1 . 1 10 10 GLN H H 1 8.339 0.000 . 1 . . . . . 540 GLN H . 52041 1 12 . 1 . 1 10 10 GLN N N 15 121.072 0.000 . 1 . . . . . 540 GLN N . 52041 1 13 . 1 . 1 11 11 LEU H H 1 8.194 0.000 . 1 . . . . . 541 LEU H . 52041 1 14 . 1 . 1 11 11 LEU N N 15 123.057 0.000 . 1 . . . . . 541 LEU N . 52041 1 15 . 1 . 1 12 12 SER H H 1 8.233 0.000 . 1 . . . . . 542 SER H . 52041 1 16 . 1 . 1 12 12 SER N N 15 116.399 0.000 . 1 . . . . . 542 SER N . 52041 1 17 . 1 . 1 13 13 GLN H H 1 8.317 0.000 . 1 . . . . . 543 GLN H . 52041 1 18 . 1 . 1 13 13 GLN N N 15 122.739 0.000 . 1 . . . . . 543 GLN N . 52041 1 19 . 1 . 1 15 15 SER H H 1 8.490 0.000 . 1 . . . . . 545 SER H . 52041 1 20 . 1 . 1 15 15 SER N N 15 116.352 0.000 . 1 . . . . . 545 SER N . 52041 1 21 . 1 . 1 16 16 SER H H 1 8.375 0.000 . 1 . . . . . 546 SER H . 52041 1 22 . 1 . 1 16 16 SER N N 15 117.873 0.000 . 1 . . . . . 546 SER N . 52041 1 23 . 1 . 1 17 17 GLY H H 1 8.408 0.000 . 1 . . . . . 547 GLY H . 52041 1 24 . 1 . 1 17 17 GLY N N 15 110.822 0.000 . 1 . . . . . 547 GLY N . 52041 1 25 . 1 . 1 18 18 ALA H H 1 8.118 0.000 . 1 . . . . . 548 ALA H . 52041 1 26 . 1 . 1 18 18 ALA N N 15 123.651 0.000 . 1 . . . . . 548 ALA N . 52041 1 27 . 1 . 1 19 19 MET H H 1 8.325 0.000 . 1 . . . . . 549 MET H . 52041 1 28 . 1 . 1 19 19 MET N N 15 119.308 0.000 . 1 . . . . . 549 MET N . 52041 1 29 . 1 . 1 20 20 GLN H H 1 8.406 0.000 . 1 . . . . . 550 GLN H . 52041 1 30 . 1 . 1 20 20 GLN N N 15 121.713 0.000 . 1 . . . . . 550 GLN N . 52041 1 31 . 1 . 1 21 21 THR H H 1 8.241 0.000 . 1 . . . . . 551 THR H . 52041 1 32 . 1 . 1 21 21 THR N N 15 115.195 0.000 . 1 . . . . . 551 THR N . 52041 1 33 . 1 . 1 22 22 SER H H 1 8.360 0.000 . 1 . . . . . 552 SER H . 52041 1 34 . 1 . 1 22 22 SER N N 15 117.684 0.000 . 1 . . . . . 552 SER N . 52041 1 35 . 1 . 1 23 23 GLN H H 1 8.434 0.000 . 1 . . . . . 553 GLN H . 52041 1 36 . 1 . 1 23 23 GLN N N 15 122.133 0.000 . 1 . . . . . 553 GLN N . 52041 1 37 . 1 . 1 24 24 SER H H 1 8.293 0.000 . 1 . . . . . 554 SER H . 52041 1 38 . 1 . 1 24 24 SER N N 15 117.146 0.000 . 1 . . . . . 554 SER N . 52041 1 39 . 1 . 1 25 25 LYS H H 1 8.219 0.000 . 1 . . . . . 555 LYS H . 52041 1 40 . 1 . 1 25 25 LYS N N 15 122.934 0.000 . 1 . . . . . 555 LYS N . 52041 1 41 . 1 . 1 26 26 TYR H H 1 8.305 0.000 . 1 . . . . . 556 TYR H . 52041 1 42 . 1 . 1 26 26 TYR N N 15 119.967 0.000 . 1 . . . . . 556 TYR N . 52041 1 43 . 1 . 1 27 27 VAL H H 1 9.272 0.000 . 1 . . . . . 557 VAL H . 52041 1 44 . 1 . 1 27 27 VAL N N 15 119.762 0.000 . 1 . . . . . 557 VAL N . 52041 1 45 . 1 . 1 28 28 LYS H H 1 9.056 0.000 . 1 . . . . . 558 LYS H . 52041 1 46 . 1 . 1 28 28 LYS N N 15 129.748 0.000 . 1 . . . . . 558 LYS N . 52041 1 47 . 1 . 1 29 29 VAL H H 1 9.010 0.000 . 1 . . . . . 559 VAL H . 52041 1 48 . 1 . 1 29 29 VAL N N 15 120.717 0.000 . 1 . . . . . 559 VAL N . 52041 1 49 . 1 . 1 30 30 TRP H H 1 7.468 0.000 . 1 . . . . . 560 TRP H . 52041 1 50 . 1 . 1 30 30 TRP N N 15 121.558 0.000 . 1 . . . . . 560 TRP N . 52041 1 51 . 1 . 1 31 31 GLU H H 1 7.168 0.000 . 1 . . . . . 561 GLU H . 52041 1 52 . 1 . 1 31 31 GLU N N 15 126.250 0.000 . 1 . . . . . 561 GLU N . 52041 1 53 . 1 . 1 32 32 GLY H H 1 7.565 0.000 . 1 . . . . . 562 GLY H . 52041 1 54 . 1 . 1 32 32 GLY N N 15 109.786 0.000 . 1 . . . . . 562 GLY N . 52041 1 55 . 1 . 1 33 33 ASN H H 1 8.524 0.000 . 1 . . . . . 563 ASN H . 52041 1 56 . 1 . 1 33 33 ASN N N 15 117.311 0.000 . 1 . . . . . 563 ASN N . 52041 1 57 . 1 . 1 34 34 LEU H H 1 8.914 0.000 . 1 . . . . . 564 LEU H . 52041 1 58 . 1 . 1 34 34 LEU N N 15 122.497 0.000 . 1 . . . . . 564 LEU N . 52041 1 59 . 1 . 1 35 35 SER H H 1 9.106 0.000 . 1 . . . . . 565 SER H . 52041 1 60 . 1 . 1 35 35 SER N N 15 123.008 0.000 . 1 . . . . . 565 SER N . 52041 1 61 . 1 . 1 36 36 GLY H H 1 8.819 0.000 . 1 . . . . . 566 GLY H . 52041 1 62 . 1 . 1 36 36 GLY N N 15 109.503 0.000 . 1 . . . . . 566 GLY N . 52041 1 63 . 1 . 1 37 37 GLN H H 1 8.488 0.000 . 1 . . . . . 567 GLN H . 52041 1 64 . 1 . 1 37 37 GLN N N 15 120.858 0.000 . 1 . . . . . 567 GLN N . 52041 1 65 . 1 . 1 38 38 ARG H H 1 8.556 0.000 . 1 . . . . . 568 ARG H . 52041 1 66 . 1 . 1 38 38 ARG N N 15 121.730 0.000 . 1 . . . . . 568 ARG N . 52041 1 67 . 1 . 1 39 39 GLN H H 1 9.731 0.000 . 1 . . . . . 569 GLN H . 52041 1 68 . 1 . 1 39 39 GLN N N 15 127.864 0.000 . 1 . . . . . 569 GLN N . 52041 1 69 . 1 . 1 40 40 GLY H H 1 8.594 0.000 . 1 . . . . . 570 GLY H . 52041 1 70 . 1 . 1 40 40 GLY N N 15 103.543 0.000 . 1 . . . . . 570 GLY N . 52041 1 71 . 1 . 1 41 41 GLN H H 1 7.826 0.000 . 1 . . . . . 571 GLN H . 52041 1 72 . 1 . 1 41 41 GLN N N 15 120.530 0.000 . 1 . . . . . 571 GLN N . 52041 1 73 . 1 . 1 43 43 VAL H H 1 8.243 0.000 . 1 . . . . . 573 VAL H . 52041 1 74 . 1 . 1 43 43 VAL N N 15 122.382 0.000 . 1 . . . . . 573 VAL N . 52041 1 75 . 1 . 1 44 44 LEU H H 1 8.605 0.000 . 1 . . . . . 574 LEU H . 52041 1 76 . 1 . 1 44 44 LEU N N 15 129.612 0.000 . 1 . . . . . 574 LEU N . 52041 1 77 . 1 . 1 45 45 ILE H H 1 8.855 0.000 . 1 . . . . . 575 ILE H . 52041 1 78 . 1 . 1 45 45 ILE N N 15 126.460 0.000 . 1 . . . . . 575 ILE N . 52041 1 79 . 1 . 1 46 46 THR H H 1 7.427 0.000 . 1 . . . . . 576 THR H . 52041 1 80 . 1 . 1 46 46 THR N N 15 108.247 0.000 . 1 . . . . . 576 THR N . 52041 1 81 . 1 . 1 47 47 ARG H H 1 8.634 0.000 . 1 . . . . . 577 ARG H . 52041 1 82 . 1 . 1 47 47 ARG N N 15 126.287 0.000 . 1 . . . . . 577 ARG N . 52041 1 83 . 1 . 1 48 48 LEU H H 1 9.510 0.000 . 1 . . . . . 578 LEU H . 52041 1 84 . 1 . 1 48 48 LEU N N 15 125.428 0.000 . 1 . . . . . 578 LEU N . 52041 1 85 . 1 . 1 49 49 GLU H H 1 8.639 0.000 . 1 . . . . . 579 GLU H . 52041 1 86 . 1 . 1 49 49 GLU N N 15 116.820 0.000 . 1 . . . . . 579 GLU N . 52041 1 87 . 1 . 1 50 50 GLY H H 1 9.620 0.000 . 1 . . . . . 580 GLY H . 52041 1 88 . 1 . 1 50 50 GLY N N 15 109.074 0.000 . 1 . . . . . 580 GLY N . 52041 1 89 . 1 . 1 51 51 TYR H H 1 9.202 0.000 . 1 . . . . . 581 TYR H . 52041 1 90 . 1 . 1 51 51 TYR N N 15 122.494 0.000 . 1 . . . . . 581 TYR N . 52041 1 91 . 1 . 1 52 52 ARG H H 1 9.041 0.000 . 1 . . . . . 582 ARG H . 52041 1 92 . 1 . 1 52 52 ARG N N 15 117.213 0.000 . 1 . . . . . 582 ARG N . 52041 1 93 . 1 . 1 53 53 SER H H 1 9.523 0.000 . 1 . . . . . 583 SER H . 52041 1 94 . 1 . 1 53 53 SER N N 15 117.804 0.000 . 1 . . . . . 583 SER N . 52041 1 95 . 1 . 1 54 54 ALA H H 1 8.521 0.000 . 1 . . . . . 584 ALA H . 52041 1 96 . 1 . 1 54 54 ALA N N 15 128.707 0.000 . 1 . . . . . 584 ALA N . 52041 1 97 . 1 . 1 55 55 SER H H 1 7.876 0.000 . 1 . . . . . 585 SER H . 52041 1 98 . 1 . 1 55 55 SER N N 15 109.292 0.000 . 1 . . . . . 585 SER N . 52041 1 99 . 1 . 1 56 56 ALA H H 1 7.422 0.000 . 1 . . . . . 586 ALA H . 52041 1 100 . 1 . 1 56 56 ALA N N 15 125.673 0.000 . 1 . . . . . 586 ALA N . 52041 1 101 . 1 . 1 57 57 SER H H 1 8.277 0.000 . 1 . . . . . 587 SER H . 52041 1 102 . 1 . 1 57 57 SER N N 15 112.501 0.000 . 1 . . . . . 587 SER N . 52041 1 103 . 1 . 1 58 58 ASP H H 1 8.529 0.000 . 1 . . . . . 588 ASP H . 52041 1 104 . 1 . 1 58 58 ASP N N 15 123.410 0.000 . 1 . . . . . 588 ASP N . 52041 1 105 . 1 . 1 59 59 SER H H 1 8.140 0.000 . 1 . . . . . 589 SER H . 52041 1 106 . 1 . 1 59 59 SER N N 15 113.925 0.000 . 1 . . . . . 589 SER N . 52041 1 107 . 1 . 1 60 60 LEU H H 1 7.119 0.000 . 1 . . . . . 590 LEU H . 52041 1 108 . 1 . 1 60 60 LEU N N 15 121.084 0.000 . 1 . . . . . 590 LEU N . 52041 1 109 . 1 . 1 61 61 ALA H H 1 7.576 0.000 . 1 . . . . . 591 ALA H . 52041 1 110 . 1 . 1 61 61 ALA N N 15 118.640 0.000 . 1 . . . . . 591 ALA N . 52041 1 111 . 1 . 1 62 62 ALA H H 1 7.136 0.000 . 1 . . . . . 592 ALA H . 52041 1 112 . 1 . 1 62 62 ALA N N 15 122.950 0.000 . 1 . . . . . 592 ALA N . 52041 1 113 . 1 . 1 63 63 ASN H H 1 8.273 0.000 . 1 . . . . . 593 ASN H . 52041 1 114 . 1 . 1 63 63 ASN N N 15 112.113 0.000 . 1 . . . . . 593 ASN N . 52041 1 115 . 1 . 1 64 64 TRP H H 1 7.564 0.000 . 1 . . . . . 594 TRP H . 52041 1 116 . 1 . 1 64 64 TRP N N 15 120.685 0.000 . 1 . . . . . 594 TRP N . 52041 1 117 . 1 . 1 67 67 THR H H 1 7.170 0.000 . 1 . . . . . 597 THR H . 52041 1 118 . 1 . 1 67 67 THR N N 15 112.234 0.000 . 1 . . . . . 597 THR N . 52041 1 119 . 1 . 1 68 68 MET H H 1 9.286 0.000 . 1 . . . . . 598 MET H . 52041 1 120 . 1 . 1 68 68 MET N N 15 125.848 0.000 . 1 . . . . . 598 MET N . 52041 1 121 . 1 . 1 69 69 GLN H H 1 8.542 0.000 . 1 . . . . . 599 GLN H . 52041 1 122 . 1 . 1 69 69 GLN N N 15 123.166 0.000 . 1 . . . . . 599 GLN N . 52041 1 123 . 1 . 1 70 70 ILE H H 1 8.654 0.000 . 1 . . . . . 600 ILE H . 52041 1 124 . 1 . 1 70 70 ILE N N 15 125.615 0.000 . 1 . . . . . 600 ILE N . 52041 1 125 . 1 . 1 71 71 VAL H H 1 9.061 0.000 . 1 . . . . . 601 VAL H . 52041 1 126 . 1 . 1 71 71 VAL N N 15 126.009 0.000 . 1 . . . . . 601 VAL N . 52041 1 127 . 1 . 1 72 72 ARG H H 1 7.494 0.000 . 1 . . . . . 602 ARG H . 52041 1 128 . 1 . 1 72 72 ARG N N 15 116.683 0.000 . 1 . . . . . 602 ARG N . 52041 1 129 . 1 . 1 73 73 LEU H H 1 8.527 0.000 . 1 . . . . . 603 LEU H . 52041 1 130 . 1 . 1 73 73 LEU N N 15 121.000 0.000 . 1 . . . . . 603 LEU N . 52041 1 131 . 1 . 1 74 74 ILE H H 1 8.660 0.000 . 1 . . . . . 604 ILE H . 52041 1 132 . 1 . 1 74 74 ILE N N 15 115.013 0.000 . 1 . . . . . 604 ILE N . 52041 1 133 . 1 . 1 75 75 SER H H 1 9.069 0.000 . 1 . . . . . 605 SER H . 52041 1 134 . 1 . 1 75 75 SER N N 15 116.403 0.000 . 1 . . . . . 605 SER N . 52041 1 135 . 1 . 1 76 76 GLN H H 1 8.746 0.000 . 1 . . . . . 606 GLN H . 52041 1 136 . 1 . 1 76 76 GLN N N 15 124.901 0.000 . 1 . . . . . 606 GLN N . 52041 1 137 . 1 . 1 77 77 ASP H H 1 8.454 0.000 . 1 . . . . . 607 ASP H . 52041 1 138 . 1 . 1 77 77 ASP N N 15 119.633 0.000 . 1 . . . . . 607 ASP N . 52041 1 139 . 1 . 1 78 78 HIS H H 1 7.784 0.000 . 1 . . . . . 608 HIS H . 52041 1 140 . 1 . 1 78 78 HIS N N 15 118.051 0.000 . 1 . . . . . 608 HIS N . 52041 1 141 . 1 . 1 79 79 MET H H 1 7.873 0.000 . 1 . . . . . 609 MET H . 52041 1 142 . 1 . 1 79 79 MET N N 15 115.598 0.000 . 1 . . . . . 609 MET N . 52041 1 143 . 1 . 1 80 80 ASN H H 1 7.562 0.000 . 1 . . . . . 610 ASN H . 52041 1 144 . 1 . 1 80 80 ASN N N 15 115.002 0.000 . 1 . . . . . 610 ASN N . 52041 1 145 . 1 . 1 81 81 ASN H H 1 7.481 0.000 . 1 . . . . . 611 ASN H . 52041 1 146 . 1 . 1 81 81 ASN N N 15 119.372 0.000 . 1 . . . . . 611 ASN N . 52041 1 147 . 1 . 1 82 82 LYS H H 1 8.782 0.000 . 1 . . . . . 612 LYS H . 52041 1 148 . 1 . 1 82 82 LYS N N 15 125.860 0.000 . 1 . . . . . 612 LYS N . 52041 1 149 . 1 . 1 83 83 GLN H H 1 8.421 0.000 . 1 . . . . . 613 GLN H . 52041 1 150 . 1 . 1 83 83 GLN N N 15 117.998 0.000 . 1 . . . . . 613 GLN N . 52041 1 151 . 1 . 1 84 84 TYR H H 1 7.563 0.000 . 1 . . . . . 614 TYR H . 52041 1 152 . 1 . 1 84 84 TYR N N 15 116.437 0.000 . 1 . . . . . 614 TYR N . 52041 1 153 . 1 . 1 85 85 VAL H H 1 7.703 0.000 . 1 . . . . . 615 VAL H . 52041 1 154 . 1 . 1 85 85 VAL N N 15 120.541 0.000 . 1 . . . . . 615 VAL N . 52041 1 155 . 1 . 1 86 86 GLY H H 1 8.505 0.000 . 1 . . . . . 616 GLY H . 52041 1 156 . 1 . 1 86 86 GLY N N 15 111.672 0.000 . 1 . . . . . 616 GLY N . 52041 1 157 . 1 . 1 87 87 LYS H H 1 7.913 0.000 . 1 . . . . . 617 LYS H . 52041 1 158 . 1 . 1 87 87 LYS N N 15 118.413 0.000 . 1 . . . . . 617 LYS N . 52041 1 159 . 1 . 1 88 88 ALA H H 1 7.612 0.000 . 1 . . . . . 618 ALA H . 52041 1 160 . 1 . 1 88 88 ALA N N 15 121.046 0.000 . 1 . . . . . 618 ALA N . 52041 1 161 . 1 . 1 89 89 ASP H H 1 8.223 0.000 . 1 . . . . . 619 ASP H . 52041 1 162 . 1 . 1 89 89 ASP N N 15 118.103 0.000 . 1 . . . . . 619 ASP N . 52041 1 163 . 1 . 1 90 90 PHE H H 1 8.861 0.000 . 1 . . . . . 620 PHE H . 52041 1 164 . 1 . 1 90 90 PHE N N 15 120.406 0.000 . 1 . . . . . 620 PHE N . 52041 1 165 . 1 . 1 91 91 LEU H H 1 9.428 0.000 . 1 . . . . . 621 LEU H . 52041 1 166 . 1 . 1 91 91 LEU N N 15 125.690 0.000 . 1 . . . . . 621 LEU N . 52041 1 167 . 1 . 1 92 92 VAL H H 1 8.176 0.000 . 1 . . . . . 622 VAL H . 52041 1 168 . 1 . 1 92 92 VAL N N 15 119.182 0.000 . 1 . . . . . 622 VAL N . 52041 1 169 . 1 . 1 93 93 PHE H H 1 9.513 0.000 . 1 . . . . . 623 PHE H . 52041 1 170 . 1 . 1 93 93 PHE N N 15 123.146 0.000 . 1 . . . . . 623 PHE N . 52041 1 171 . 1 . 1 94 94 ARG H H 1 9.476 0.000 . 1 . . . . . 624 ARG H . 52041 1 172 . 1 . 1 94 94 ARG N N 15 122.153 0.000 . 1 . . . . . 624 ARG N . 52041 1 173 . 1 . 1 95 95 ALA H H 1 8.875 0.000 . 1 . . . . . 625 ALA H . 52041 1 174 . 1 . 1 95 95 ALA N N 15 128.611 0.000 . 1 . . . . . 625 ALA N . 52041 1 175 . 1 . 1 96 96 MET H H 1 8.617 0.000 . 1 . . . . . 626 MET H . 52041 1 176 . 1 . 1 96 96 MET N N 15 120.561 0.000 . 1 . . . . . 626 MET N . 52041 1 177 . 1 . 1 97 97 SER H H 1 7.911 0.000 . 1 . . . . . 627 SER H . 52041 1 178 . 1 . 1 97 97 SER N N 15 112.152 0.000 . 1 . . . . . 627 SER N . 52041 1 179 . 1 . 1 98 98 GLN H H 1 8.547 0.000 . 1 . . . . . 628 GLN H . 52041 1 180 . 1 . 1 98 98 GLN N N 15 121.219 0.000 . 1 . . . . . 628 GLN N . 52041 1 181 . 1 . 1 99 99 HIS H H 1 8.056 0.000 . 1 . . . . . 629 HIS H . 52041 1 182 . 1 . 1 99 99 HIS N N 15 122.765 0.000 . 1 . . . . . 629 HIS N . 52041 1 183 . 1 . 1 100 100 GLY H H 1 8.997 0.000 . 1 . . . . . 630 GLY H . 52041 1 184 . 1 . 1 100 100 GLY N N 15 118.484 0.000 . 1 . . . . . 630 GLY N . 52041 1 185 . 1 . 1 101 101 PHE H H 1 12.357 0.000 . 1 . . . . . 631 PHE H . 52041 1 186 . 1 . 1 101 101 PHE N N 15 127.538 0.000 . 1 . . . . . 631 PHE N . 52041 1 187 . 1 . 1 102 102 LEU H H 1 7.523 0.000 . 1 . . . . . 632 LEU H . 52041 1 188 . 1 . 1 102 102 LEU N N 15 114.611 0.000 . 1 . . . . . 632 LEU N . 52041 1 189 . 1 . 1 103 103 GLY H H 1 7.427 0.000 . 1 . . . . . 633 GLY H . 52041 1 190 . 1 . 1 103 103 GLY N N 15 105.456 0.000 . 1 . . . . . 633 GLY N . 52041 1 191 . 1 . 1 104 104 GLN H H 1 7.794 0.000 . 1 . . . . . 634 GLN H . 52041 1 192 . 1 . 1 104 104 GLN N N 15 121.005 0.000 . 1 . . . . . 634 GLN N . 52041 1 193 . 1 . 1 105 105 LEU H H 1 7.625 0.000 . 1 . . . . . 635 LEU H . 52041 1 194 . 1 . 1 105 105 LEU N N 15 118.298 0.000 . 1 . . . . . 635 LEU N . 52041 1 195 . 1 . 1 106 106 GLN H H 1 7.480 0.000 . 1 . . . . . 636 GLN H . 52041 1 196 . 1 . 1 106 106 GLN N N 15 116.749 0.000 . 1 . . . . . 636 GLN N . 52041 1 197 . 1 . 1 107 107 ASP H H 1 8.636 0.000 . 1 . . . . . 637 ASP H . 52041 1 198 . 1 . 1 107 107 ASP N N 15 120.212 0.000 . 1 . . . . . 637 ASP N . 52041 1 199 . 1 . 1 108 108 LYS H H 1 8.037 0.000 . 1 . . . . . 638 LYS H . 52041 1 200 . 1 . 1 108 108 LYS N N 15 114.670 0.000 . 1 . . . . . 638 LYS N . 52041 1 201 . 1 . 1 109 109 LYS H H 1 7.642 0.000 . 1 . . . . . 639 LYS H . 52041 1 202 . 1 . 1 109 109 LYS N N 15 117.038 0.000 . 1 . . . . . 639 LYS N . 52041 1 203 . 1 . 1 110 110 LEU H H 1 8.395 0.000 . 1 . . . . . 640 LEU H . 52041 1 204 . 1 . 1 110 110 LEU N N 15 119.619 0.000 . 1 . . . . . 640 LEU N . 52041 1 205 . 1 . 1 111 111 CYS H H 1 9.276 0.000 . 1 . . . . . 641 CYS H . 52041 1 206 . 1 . 1 111 111 CYS N N 15 116.354 0.000 . 1 . . . . . 641 CYS N . 52041 1 207 . 1 . 1 112 112 ALA H H 1 9.240 0.000 . 1 . . . . . 642 ALA H . 52041 1 208 . 1 . 1 112 112 ALA N N 15 124.519 0.000 . 1 . . . . . 642 ALA N . 52041 1 209 . 1 . 1 113 113 VAL H H 1 8.545 0.000 . 1 . . . . . 643 VAL H . 52041 1 210 . 1 . 1 113 113 VAL N N 15 121.342 0.000 . 1 . . . . . 643 VAL N . 52041 1 211 . 1 . 1 114 114 ILE H H 1 9.252 0.000 . 1 . . . . . 644 ILE H . 52041 1 212 . 1 . 1 114 114 ILE N N 15 129.553 0.000 . 1 . . . . . 644 ILE N . 52041 1 213 . 1 . 1 115 115 GLN H H 1 8.605 0.000 . 1 . . . . . 645 GLN H . 52041 1 214 . 1 . 1 115 115 GLN N N 15 126.989 0.000 . 1 . . . . . 645 GLN N . 52041 1 215 . 1 . 1 116 116 LEU H H 1 7.967 0.000 . 1 . . . . . 646 LEU H . 52041 1 216 . 1 . 1 116 116 LEU N N 15 128.544 0.000 . 1 . . . . . 646 LEU N . 52041 1 217 . 1 . 1 118 118 SER H H 1 9.372 0.000 . 1 . . . . . 648 SER H . 52041 1 218 . 1 . 1 118 118 SER N N 15 112.965 0.000 . 1 . . . . . 648 SER N . 52041 1 219 . 1 . 1 119 119 GLN H H 1 7.283 0.000 . 1 . . . . . 649 GLN H . 52041 1 220 . 1 . 1 119 119 GLN N N 15 119.312 0.000 . 1 . . . . . 649 GLN N . 52041 1 221 . 1 . 1 120 120 THR H H 1 8.906 0.000 . 1 . . . . . 650 THR H . 52041 1 222 . 1 . 1 120 120 THR N N 15 116.768 0.000 . 1 . . . . . 650 THR N . 52041 1 223 . 1 . 1 121 121 LEU H H 1 8.881 0.000 . 1 . . . . . 651 LEU H . 52041 1 224 . 1 . 1 121 121 LEU N N 15 129.014 0.000 . 1 . . . . . 651 LEU N . 52041 1 225 . 1 . 1 122 122 LEU H H 1 8.975 0.000 . 1 . . . . . 652 LEU H . 52041 1 226 . 1 . 1 122 122 LEU N N 15 126.505 0.000 . 1 . . . . . 652 LEU N . 52041 1 227 . 1 . 1 123 123 LEU H H 1 9.107 0.000 . 1 . . . . . 653 LEU H . 52041 1 228 . 1 . 1 123 123 LEU N N 15 123.688 0.000 . 1 . . . . . 653 LEU N . 52041 1 229 . 1 . 1 124 124 SER H H 1 9.222 0.000 . 1 . . . . . 654 SER H . 52041 1 230 . 1 . 1 124 124 SER N N 15 118.864 0.000 . 1 . . . . . 654 SER N . 52041 1 231 . 1 . 1 125 125 VAL H H 1 9.301 0.000 . 1 . . . . . 655 VAL H . 52041 1 232 . 1 . 1 125 125 VAL N N 15 123.637 0.000 . 1 . . . . . 655 VAL N . 52041 1 233 . 1 . 1 126 126 SER H H 1 8.449 0.000 . 1 . . . . . 656 SER H . 52041 1 234 . 1 . 1 126 126 SER N N 15 122.157 0.000 . 1 . . . . . 656 SER N . 52041 1 235 . 1 . 1 127 127 ASP H H 1 8.612 0.000 . 1 . . . . . 657 ASP H . 52041 1 236 . 1 . 1 127 127 ASP N N 15 118.570 0.000 . 1 . . . . . 657 ASP N . 52041 1 237 . 1 . 1 128 128 LYS H H 1 8.248 0.000 . 1 . . . . . 658 LYS H . 52041 1 238 . 1 . 1 128 128 LYS N N 15 120.840 0.000 . 1 . . . . . 658 LYS N . 52041 1 239 . 1 . 1 129 129 ALA H H 1 8.383 0.000 . 1 . . . . . 659 ALA H . 52041 1 240 . 1 . 1 129 129 ALA N N 15 124.392 0.000 . 1 . . . . . 659 ALA N . 52041 1 241 . 1 . 1 130 130 CYS H H 1 8.418 0.000 . 1 . . . . . 660 CYS H . 52041 1 242 . 1 . 1 130 130 CYS N N 15 109.850 0.000 . 1 . . . . . 660 CYS N . 52041 1 243 . 1 . 1 131 131 ARG H H 1 8.230 0.000 . 1 . . . . . 661 ARG H . 52041 1 244 . 1 . 1 131 131 ARG N N 15 121.753 0.000 . 1 . . . . . 661 ARG N . 52041 1 245 . 1 . 1 132 132 LEU H H 1 9.361 0.000 . 1 . . . . . 662 LEU H . 52041 1 246 . 1 . 1 132 132 LEU N N 15 126.872 0.000 . 1 . . . . . 662 LEU N . 52041 1 247 . 1 . 1 133 133 ILE H H 1 9.014 0.000 . 1 . . . . . 663 ILE H . 52041 1 248 . 1 . 1 133 133 ILE N N 15 121.989 0.000 . 1 . . . . . 663 ILE N . 52041 1 249 . 1 . 1 134 134 GLY H H 1 8.976 0.000 . 1 . . . . . 664 GLY H . 52041 1 250 . 1 . 1 134 134 GLY N N 15 111.615 0.000 . 1 . . . . . 664 GLY N . 52041 1 251 . 1 . 1 135 135 MET H H 1 9.114 0.000 . 1 . . . . . 665 MET H . 52041 1 252 . 1 . 1 135 135 MET N N 15 124.132 0.000 . 1 . . . . . 665 MET N . 52041 1 253 . 1 . 1 136 136 LEU H H 1 9.003 0.000 . 1 . . . . . 666 LEU H . 52041 1 254 . 1 . 1 136 136 LEU N N 15 128.271 0.000 . 1 . . . . . 666 LEU N . 52041 1 255 . 1 . 1 137 137 PHE H H 1 9.490 0.000 . 1 . . . . . 667 PHE H . 52041 1 256 . 1 . 1 137 137 PHE N N 15 127.193 0.000 . 1 . . . . . 667 PHE N . 52041 1 257 . 1 . 1 139 139 GLY H H 1 8.268 0.000 . 1 . . . . . 669 GLY H . 52041 1 258 . 1 . 1 139 139 GLY N N 15 110.216 0.000 . 1 . . . . . 669 GLY N . 52041 1 259 . 1 . 1 140 140 ASP H H 1 8.191 0.000 . 1 . . . . . 670 ASP H . 52041 1 260 . 1 . 1 140 140 ASP N N 15 118.096 0.000 . 1 . . . . . 670 ASP N . 52041 1 261 . 1 . 1 141 141 MET H H 1 7.917 0.000 . 1 . . . . . 671 MET H . 52041 1 262 . 1 . 1 141 141 MET N N 15 120.335 0.000 . 1 . . . . . 671 MET N . 52041 1 263 . 1 . 1 142 142 VAL H H 1 8.126 0.000 . 1 . . . . . 672 VAL H . 52041 1 264 . 1 . 1 142 142 VAL N N 15 122.921 0.000 . 1 . . . . . 672 VAL N . 52041 1 265 . 1 . 1 143 143 VAL H H 1 7.865 0.000 . 1 . . . . . 673 VAL H . 52041 1 266 . 1 . 1 143 143 VAL N N 15 122.457 0.000 . 1 . . . . . 673 VAL N . 52041 1 267 . 1 . 1 144 144 PHE H H 1 7.902 0.000 . 1 . . . . . 674 PHE H . 52041 1 268 . 1 . 1 144 144 PHE N N 15 122.020 0.000 . 1 . . . . . 674 PHE N . 52041 1 269 . 1 . 1 145 145 LYS H H 1 8.173 0.000 . 1 . . . . . 675 LYS H . 52041 1 270 . 1 . 1 145 145 LYS N N 15 123.711 0.000 . 1 . . . . . 675 LYS N . 52041 1 271 . 1 . 1 147 147 GLN H H 1 8.529 0.000 . 1 . . . . . 677 GLN H . 52041 1 272 . 1 . 1 147 147 GLN N N 15 121.322 0.000 . 1 . . . . . 677 GLN N . 52041 1 273 . 1 . 1 148 148 ILE H H 1 8.217 0.000 . 1 . . . . . 678 ILE H . 52041 1 274 . 1 . 1 148 148 ILE N N 15 124.170 0.000 . 1 . . . . . 678 ILE N . 52041 1 275 . 1 . 1 150 150 ASN H H 1 8.007 0.000 . 1 . . . . . 680 ASN H . 52041 1 276 . 1 . 1 150 150 ASN N N 15 124.775 0.000 . 1 . . . . . 680 ASN N . 52041 1 stop_ save_